CID 13563860

4-decylpyridine

Structural Information

Molecular Formula
C15H25N
SMILES
CCCCCCCCCCC1=CC=NC=C1
InChI
InChI=1S/C15H25N/c1-2-3-4-5-6-7-8-9-10-15-11-13-16-14-12-15/h11-14H,2-10H2,1H3
InChIKey
YHYRSCXMQFIFNC-UHFFFAOYSA-N
Compound name
4-decylpyridine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

110
Patents

219.1987 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.20598 155.7
[M+Na]+ 242.18792 160.6
[M-H]- 218.19142 156.5
[M+NH4]+ 237.23252 172.9
[M+K]+ 258.16186 157.1
[M+H-H2O]+ 202.19596 148.0
[M+HCOO]- 264.19690 177.0
[M+CH3COO]- 278.21255 192.3
[M+Na-2H]- 240.17337 160.8
[M]+ 219.19815 158.3
[M]- 219.19925 158.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe